N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-2-(4,6,7-trimethyl-1-benzofuran-3-yl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-2-(4,6,7-trimethyl-1-benzofuran-3-yl)ethanamide Openeye Name: N-(2-cyanoethyl)-N-(3-pyridylmethyl)-2-(4,6,7-trimethylbenzofuran-3-yl)acetamide CAS Name: N-(2-cyanoethyl)-N-(3-pyridinylmethyl)-2-(4,6,7-trimethyl-3-benzofuranyl)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-2-(4,6,7-trimethyl-1-benzofuran-3-yl)acetamide Traditional Name: N-(2-cyanoethyl)-N-(3-pyridylmethyl)-2-(4,6,7-trimethylbenzofuran-3-yl)acetamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=CO2)CC(=O)N(CCC#N)CC3=CN=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C2=C1C(=CO2)CC(=O)N(CCC#N)CC3=CN=CC=C3)C)C

InChI

InChI=1S/C22H23N3O2/c1-15-10-16(2)21-19(14-27-22(21)17(15)3)11-20(26)25(9-5-7-23)13-18-6-4-8-24-12-18/h4,6,8,10,12,14H,5,9,11,13H2,1-3H3